SCHEMBL6911632

SCHEMBL6911632

FC(OCC1CO1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1071671 0.93 ALDH1A1 (0.35) ALDH1A1TSHRMAPK1TDP1
SCHEMBL6243102 0.90 ALDH1A1 (0.33) ALDH1A1TSHRMAPK1TDP1
SCHEMBL711058 0.87 ALDH1A1 (0.32) ALDH1A1TSHRMAPK1
SCHEMBL711179 0.85 ALDH1A1 (0.32) ALDH1A1TSHRMAPK1
SCHEMBL9513874 0.84 TSHR (0.35) ALDH1A1TSHRMAPK1TDP1
SCHEMBL6396180 0.84 ALDH1A1 (0.30) ALDH1A1
SCHEMBL5077997 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL5859261 0.81 ALDH1A1 (0.36) ALDH1A1TSHRMAPK1
SCHEMBL28419865 0.81 ALDH1A1 (0.36) ALDH1A1TSHRMAPK1
SCHEMBL10943101 0.80 ALDH1A1 (0.36) ALDH1A1TSHRMAPK1TDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1034204-B1 ROOM TEMPERATURE CURABLE SILANE TERMINATED AND STABLE WATERBORNE POLYURETHANE DISPERSIONS WHICH CONTAIN FLUORINE AND/OR SILICONE AND LOW SURFACE ENERGY COATINGS PREPARED THEREFROM MINNESOTA MINING & MFG (US) 2004-02-11 EP disclosed
US-6313335-B1 Room temperature curable silane terminated and stable waterborne polyurethane dispersions which contain fluorine and/or silicone and low surface energy coatings prepared therefrom 3M INNOVATIVE PROPERTIES 2001-11-06 US disclosed